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20132025
most cited-Machine Learning for Potential Energy Surfaces: A PIP approach to bring a DFT-based PES to CCSD(T) Level of Theory

160 citations · 977 across the 26 of their papers we have counts for

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physics.comp-ph2013★ 33 cited

Graphics processing units accelerated semiclassical initial value representation molecular dynamics

Dario Tamascelli, Francesco S. Dambrosio, Riccardo Conte +1

This paper presents a Graphics Processing Units (GPUs) implementation of the Semiclassical Initial Value Representation (SC-IVR) propagator for vibrational molecular spectroscopy c…